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Keywords = physical and mechanical properties

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33 pages, 4989 KB  
Article
Fly Ash as a Secondary Raw Material Improving the Sustainable Characteristics of a Conventional Silicoaluminate Refractory Castable
by Jesús Fernando López-Perales, Leonel Díaz-Tato, Sinuhe Uriel Costilla-Aguilar, Yadira González-Carranza, José Eulalio Contreras de León and Edén Amaral Rodríguez-Castellanos
Inorganics 2025, 13(11), 367; https://doi.org/10.3390/inorganics13110367 (registering DOI) - 2 Nov 2025
Abstract
The global reliance on coal-fired power generation continues to produce vast quantities of fly ash, exceeding 500 million tons annually, with limited recycling rates. Given its high silica (SiO2) and alumina (Al2O3) contents, fly ash represents a [...] Read more.
The global reliance on coal-fired power generation continues to produce vast quantities of fly ash, exceeding 500 million tons annually, with limited recycling rates. Given its high silica (SiO2) and alumina (Al2O3) contents, fly ash represents a promising alternative raw material for sustainable refractory production. In this study, four aluminosilicate refractory castables were formulated using bauxite, calcined flint clay, kyanite, calcium aluminate cement, and microsilica, in which the fine fraction of flint clay was partially replaced by 0, 5, 10, and 15 wt.% fly ash. The specimens were dried at 120 °C and sintered at 850, 1050, and 1400 °C for 4 h. Their physical and mechanical properties were systematically evaluated, while phase evolution and microstructural development were analyzed through X-ray diffraction (XRD) and scanning electron microscopy (SEM). The results revealed that the incorporation of 10 wt.% fly ash (10FAC) provided the optimal balance between densification and strength, achieving compressive strengths of 45.0 MPa and 65.3 MPa after sintering at 1050 °C and 1400 °C, respectively. This improvement is attributed to the formation of a SiO2-rich liquid phase derived from fly ash impurities, which promoted the in-situ crystallization of acicular secondary mullite and enhanced interparticle bonding among corundum grains. The 10FAC castable also exhibited only a slight increase in apparent porosity (26.39%) compared with the reference (25.74%), indicating effective sintering without excessive vitrification. Overall, the study demonstrates the technical viability of using fly ash as a sustainable substitute for flint clay in refractory castables. The findings contribute to advancing circular economy principles by promoting industrial waste valorization and resource conservation, offering a low-carbon pathway for the development of high-performance refractory materials for structural and thermal applications in energy-intensive industries. Full article
(This article belongs to the Special Issue Recent Advances in Sustainable Ceramic Matrix Composites)
23 pages, 9932 KB  
Article
Explicit Crystal Plasticity Modeling of Texture Evolution in Nonlinear Twist Extrusion
by Ülke Şimşek, Hiroyuki Miyamoto and Tuncay Yalçınkaya
Crystals 2025, 15(11), 950; https://doi.org/10.3390/cryst15110950 (registering DOI) - 2 Nov 2025
Abstract
The Nonlinear Twist Extrusion (NLTE) method, a novel severe plastic deformation (SPD) technique, aims to enhance grain refinement and achieve a more uniform plastic strain distribution. Grain size and its uniform distribution strongly influence the physical properties of metals. Therefore, predicting texture evolution [...] Read more.
The Nonlinear Twist Extrusion (NLTE) method, a novel severe plastic deformation (SPD) technique, aims to enhance grain refinement and achieve a more uniform plastic strain distribution. Grain size and its uniform distribution strongly influence the physical properties of metals. Therefore, predicting texture evolution during processing is essential for optimizing forming parameters and improving material performance. In this study, a rate-dependent crystal plasticity formulation is implemented in an explicit framework in Abaqus finite element software, based on a finite strain approach with multiplicative decomposition of the deformation gradient. Crystal plasticity finite element (CPFEM) simulations are conducted on single-crystal copper under boundary conditions representing the NLTE process. The influence of dynamic friction coefficients on texture evolution is systematically investigated, and the results are compared with experimental observations. The study provides new insights into deformation mechanisms during NLTE and highlights the strong correlation between texture development and forming parameters. Full article
(This article belongs to the Section Crystalline Metals and Alloys)
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16 pages, 5621 KB  
Article
Optimized 3D-Printed Polylactic Acid/Graphene Oxide Scaffolds for Enhanced Bone Regeneration
by Jung-Tae Lee, Dajung Lee, Ye-Seul Jung, Sung-Ho Lee, Sungtae Kim, Bongju Kim and Dong-Wook Han
Bioengineering 2025, 12(11), 1192; https://doi.org/10.3390/bioengineering12111192 (registering DOI) - 1 Nov 2025
Abstract
Background: Three-dimensional (3D) printed scaffolds have emerged as promising tools for bone regeneration, but the optimal structural design and pore size remain unclear. Polylactic acid (PLA) reinforced with graphene oxide (GO) offers enhanced mechanical and biological performance, yet systematic evaluation of architecture and [...] Read more.
Background: Three-dimensional (3D) printed scaffolds have emerged as promising tools for bone regeneration, but the optimal structural design and pore size remain unclear. Polylactic acid (PLA) reinforced with graphene oxide (GO) offers enhanced mechanical and biological performance, yet systematic evaluation of architecture and pore size is limited. Methods: Two scaffold architectures (lattice-type and dode-type) with multiple pore sizes were fabricated using UV-curable PLA/GO resin. Physical accuracy, porosity, and mechanical properties were assessed through compression and fatigue testing. Based on in vitro screening, four pore sizes (930 μm, 690 μm, 558 μm, 562 μm) within the dode-type structure were analyzed. The 558 μm and 562 μm scaffolds, showing distinct fracture thresholds, were further evaluated in rat and rabbit calvarial defect models for inflammation and bone regeneration. Results: In vitro testing revealed that while 930 μm and 690 μm scaffolds exhibited superior compressive strength, the 562 μm scaffold showed a unique critical fracture behavior, and the 558 μm scaffold offered comparable stability with higher resistance to premature failure. In vivo studies confirmed excellent biocompatibility in both groups, with early bone formation favored in the 558 μm scaffold and more continuous and mature bone observed in the 562 μm scaffold at later stages. Conclusions: This stepwise strategy—from structural design to pore size screening and preclinical validation—demonstrates that threshold-level mechanical properties can influence osteogenesis. PLA/GO scaffolds optimized at 558 μm and 562 μm provide a translationally relevant balance between mechanical stability and biological performance for bone tissue engineering. Full article
(This article belongs to the Special Issue Advanced 3D-Printed Biomaterials in Dentistry)
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15 pages, 1024 KB  
Article
Incorporation of Nanofibers and Cellulose Nanocrystals from Guadua Bamboo in the Properties of Cementitious Composites
by Tiago Henrique da Costa Viana, Antonia Eliane Costa Sena, Maurício da Silva Souza, Yuri Sotero Bomfim Fraga, José Roberto de Lima Murad and Anselmo Fortunato Ruiz Rodriguez
Buildings 2025, 15(21), 3938; https://doi.org/10.3390/buildings15213938 (registering DOI) - 1 Nov 2025
Abstract
In this work, nanofibers and cellulose nanocrystals from the native Amazonian bamboo Guadua weberbabeuri were used in structural cementitious composites. Through the preparation of bamboo nanofibers—bleached cellulose pulp (BCP) and cellulose nanocrystals (CNC), as well as obtaining shredded bamboo (SB) and delignified cellulose [...] Read more.
In this work, nanofibers and cellulose nanocrystals from the native Amazonian bamboo Guadua weberbabeuri were used in structural cementitious composites. Through the preparation of bamboo nanofibers—bleached cellulose pulp (BCP) and cellulose nanocrystals (CNC), as well as obtaining shredded bamboo (SB) and delignified cellulose pulp (DCP)—the additions corresponding to the additive nanomaterials were characterized with physical tests such as water absorption, specific mass, void index, and dimensional variation. A mechanical tensile strength test was carried out at 28 days, with an incorporation content of 0.40% of mass in relation to the cement. The results indicated, in relation to the control, improvement in the physical properties, especially in the additions with nanofibers and cellulose nanocrystals. For the mechanical tensile strength tests, the indicator allowed an increase of 14.60% with the addition of nanofibers and 12.70% in the addition of nanocrystals. Therefore, with the execution carried out, it could be seen that the incorporation was able to generate optimization in the joint performance of the materials under analysis, reinforcing the practices and ideals arising from civil engineering, nanotechnology, and sustainability. Full article
(This article belongs to the Special Issue Application of Nanotechnology in Building Materials)
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26 pages, 1953 KB  
Review
Machine Learning for Thermal Transport Prediction in Nanoporous Materials: Progress, Challenges, and Opportunities
by Amirehsan Ghasemi and Murat Barisik
Nanomaterials 2025, 15(21), 1660; https://doi.org/10.3390/nano15211660 (registering DOI) - 31 Oct 2025
Abstract
Predicting the thermal properties of nanoporous materials is a major challenge that affects their applications in efficient thermal insulation and energy storage. This narrative review discusses the application of machine learning models in nanoporous materials, including covalent organic frameworks, metal–organic frameworks, aerogels, and [...] Read more.
Predicting the thermal properties of nanoporous materials is a major challenge that affects their applications in efficient thermal insulation and energy storage. This narrative review discusses the application of machine learning models in nanoporous materials, including covalent organic frameworks, metal–organic frameworks, aerogels, and zeolites. It discusses model advancements, with a focus on predictive accuracy and computational efficiency. This includes models such as convolutional neural networks, graph neural networks, and physics-informed neural networks. This study also addresses the limitations of these data-driven models, including data availability, challenges in maintaining physical consistency, and difficulties in generalizing across various material families. Additionally, it covers emerging approaches such as multimodal and transfer learning, which are explored for their potential to reduce computational costs. Moreover, the benefits of interpretable machine learning methods for understanding underlying physical mechanisms are introduced and highlighted. This review provides comprehensive and practical guidelines for researchers using machine learning approaches in the study and design of nanoporous materials. Full article
(This article belongs to the Special Issue Advances of Machine Learning in Nanoscale Materials Science)
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16 pages, 1446 KB  
Article
Research on High-Frequency Impedance Characteristics of Damaged Circuit Breaker Closing Resistance
by Ce Zhang, Bo Niu, Feiyue Ma, Lingjun Yin, Shangpeng Sun and Xutao Han
Energies 2025, 18(21), 5768; https://doi.org/10.3390/en18215768 (registering DOI) - 31 Oct 2025
Abstract
The closing resistor in a circuit breaker are prone to damage during operation due to extreme factors such as over-voltage, over-current, and mechanical shock, which alter their high-frequency impedance characteristics. Comparing impedance before and after damage can indicate the severity of degradation. However, [...] Read more.
The closing resistor in a circuit breaker are prone to damage during operation due to extreme factors such as over-voltage, over-current, and mechanical shock, which alter their high-frequency impedance characteristics. Comparing impedance before and after damage can indicate the severity of degradation. However, the high-frequency impedance properties of damaged closing resistors remain insufficiently understood. This study investigates three classic damage types through simulation and external testing on a physical circuit breaker, validating the accuracy of the simulation results. Further high-frequency impedance measurements inside the tank examine the characteristics under varying damage degrees. Results show that external testing reflects the intrinsic impedance changes in the resistor string, exhibiting primarily resistive and inductive traits, with negligible capacitive influence. In contrast, internal measurements are affected by the tank’s capacitance, leading to a resonance point in the high-frequency range. Different damage degrees cause noticeable shifts in the resonance frequency and a gradual increase in impedance magnitude. These findings offer practical guidance for field inspection of circuit breaker closing resistor conditions using high-frequency impedance techniques. Full article
36 pages, 2184 KB  
Review
Probing Supernova Diversity Through High-Cadence Optical Observations
by Kuntal Misra, Bhavya Ailawadhi, Raya Dastidar, Monalisa Dubey, Naveen Dukiya, Anjasha Gangopadhyay, Divyanshu Janghel, Kumar Pranshu and Mridweeka Singh
Universe 2025, 11(11), 361; https://doi.org/10.3390/universe11110361 (registering DOI) - 31 Oct 2025
Abstract
Supernovae (SNe) are among the most energetic and transient events in the universe, offering crucial insights into stellar evolution, nucleosynthesis, and cosmic expansion. Optical observations have historically played a central role in the discovery, classification, and physical interpretation of SNe. In this review, [...] Read more.
Supernovae (SNe) are among the most energetic and transient events in the universe, offering crucial insights into stellar evolution, nucleosynthesis, and cosmic expansion. Optical observations have historically played a central role in the discovery, classification, and physical interpretation of SNe. In this review, we summarize recent progress in the optical study of SNe, with a focus on advancements in time-domain surveys and photometric and spectroscopic follow-up strategies. High-cadence optical monitoring is pivotal in capturing the diverse behaviors of SNe, from early-time emission to late-phase decline. Leveraging data from ARIES telescopes and national/international collaborations, we systematically investigate various SN types, including Type Iax, IIP/L, IIb, IIn/Ibn and Ib/c events. Our analysis includes light curve evolution and spectral diagnostics, providing insights into early emission signatures (e.g., shock breakout), progenitor systems, explosion mechanisms, and circumstellar medium (CSM) interactions. Through detailed case studies, we demonstrate the importance of both early-time and nebular-phase observations in constraining progenitor and CSM properties. This comprehensive approach underscores the importance of coordinated global efforts in time-domain astronomy to deepen our understanding of SN diversity. We conclude by discussing the challenges and opportunities for future optical studies in the era of wide-field observatories such as the Vera C. Rubin Observatory (hereafter Rubin), with an emphasis on detection strategies, automation, and rapid-response capabilities. Full article
(This article belongs to the Special Issue A Multiwavelength View of Supernovae)
26 pages, 11521 KB  
Article
Mechanism of Burial Depth Effect on Recovery Under Different Coupling Models: Response and Simplification
by Zhanglei Fan, Gangwei Fan, Dongsheng Zhang, Tao Luo, Xuesen Han, Guangzheng Xu and Haochen Tong
Appl. Sci. 2025, 15(21), 11657; https://doi.org/10.3390/app152111657 (registering DOI) - 31 Oct 2025
Abstract
Coalbed methane (CBM) development involves multiple interacting physical fields, and different coupling schemes can lead to distinctly different production behaviors. A thermo-hydro-mechanical model accounting for gas–water two-phase flow and matrix dynamic diffusion (TP-D-THM) is developed and validated, achieving an error rate below 10%. [...] Read more.
Coalbed methane (CBM) development involves multiple interacting physical fields, and different coupling schemes can lead to distinctly different production behaviors. A thermo-hydro-mechanical model accounting for gas–water two-phase flow and matrix dynamic diffusion (TP-D-THM) is developed and validated, achieving an error rate below 10%. By embedding the numerically estimated reservoir physical parameters of the Qinshui Basin into the numerical model, multi-field couplings during CBM production, the evolution of physical parameters, and the depth-dependent effects on production characteristics were revealed. The main findings are as follows: The inhibitory effect of water on CBM recovery consistently exceeds the promoting effect of temperature. As burial depth expands, the inhibitory effect first diminishes, then intensifies, ranging from 19.73% to 28.41%, while the thermal promotion effect exhibits a monotonically increasing trend, fluctuating between 8.55% and 16.33% and stabilizing below 1000 m. Temperature and burial depth do not alter the trend in gas production rate. For equilibrium permeability, reproducing a decrease–increase–decrease rate pattern requires explicit inclusion of water and matrix-fracture mass exchange terms, which can explain why different scholars obtained varying gas production rate trends using the THM model. Matrix adsorption-induced strain is the primary control on permeability evolution, and temperature amplifies the magnitude of permeability change. The critical depth essentially reflects the statistical characteristics of reservoir petrophysical properties. A dimensionless critical depth criterion has been proposed, which comprehensively considers reservoir pressure, permeability, and a fractional coverage index. For burial depths ranging from 650 to 1350 m, the TP-D-THM model can be simplified to the gas-mechanical model accounts for matrix dynamic diffusion (D-HM) with an error below 5%, indicating that thermal and water effects nearly cancel each other. Full article
(This article belongs to the Special Issue Innovations in Rock Mechanics and Mining Engineering)
16 pages, 5971 KB  
Article
Development of Acoustic Absorbent Materials Using Pine Needles
by Jaime D. Ruiz-Martinez, Begona Peceño, Carlos J. Carrasco, Daniel Orejón, Yolanda Luna-Galiano and Carlos Leiva
Materials 2025, 18(21), 4978; https://doi.org/10.3390/ma18214978 (registering DOI) - 31 Oct 2025
Abstract
Acoustic absorbing materials made from waste plants or trees represent a sustainable source for noise reduction products and applications such as home acoustic insulation and/or traffic road noise reduction barriers. The primary aim of this work is hence to demonstrate the potential application [...] Read more.
Acoustic absorbing materials made from waste plants or trees represent a sustainable source for noise reduction products and applications such as home acoustic insulation and/or traffic road noise reduction barriers. The primary aim of this work is hence to demonstrate the potential application of pine needle waste as the main constituent in acoustic absorbing materials while resin is used as binder. Once the samples have been manufactured, their different physical (density and porous structure), mechanical (compressive strength), and sound-insulating (sound absorption coefficient) properties are characterized. The influence of the ratio of pine needle/resin, length of the pine needle fragments, and thickness of the samples on the different properties has been explored. As the ratio of pine needles/resin increases so does the porosity, although the compressive strength decreases. To highlight this, the noise reduction coefficient is in the range of 0.67 and 0.71 (for 4 cm of thickness), which is higher than that reported for other typical sound absorption materials. An excess of resin produces a clogging phenomenon at the bottom of the samples, producing a reflective layer instead of an absorbent one, which could be used positively to increase the acoustic absorption coefficient in materials with combinations of sections with different needle/resin ratios. Owed to its low weight and high sound absorption coefficients at low frequencies (characteristic of road noise), PN finds usefulness in the manufacturing of environmentally friendly sound-absorbing materials as road insulation barriers. Full article
(This article belongs to the Section Construction and Building Materials)
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27 pages, 6442 KB  
Review
The Role of Hollow Glass Microspheres as Functional Fillers in Fiber-Reinforced Polymer Composites: A Review
by Dehenenet Flatie Tassaw, Marcin Barburski and Bantamlak Birlie Kassie
Materials 2025, 18(21), 4974; https://doi.org/10.3390/ma18214974 (registering DOI) - 31 Oct 2025
Viewed by 186
Abstract
Fiber-reinforced polymer composites (FRPCs) have gained increasing attention as lightweight structural materials with tailored mechanical, thermal, and functional properties for diverse engineering applications. However, achieving optimal performance requires overcoming challenges such as poor interfacial bonding, high density of conventional fillers, and limitations in [...] Read more.
Fiber-reinforced polymer composites (FRPCs) have gained increasing attention as lightweight structural materials with tailored mechanical, thermal, and functional properties for diverse engineering applications. However, achieving optimal performance requires overcoming challenges such as poor interfacial bonding, high density of conventional fillers, and limitations in multifunctionality. Hollow Glass Microspheres (HGMs), owing to their unique spherical morphology, low density, high strength-to-weight ratio, and tunable physical–chemical characteristics, have emerged as promising functional fillers for FRPCs. This review provides a comprehensive overview of the structural features, chemical composition, and synthesis techniques of HGMs, followed by an outline of FRPCs systems with emphasis on matrix and fiber types, their functional requirements, and the critical role of fillers. The discussion highlights how HGMs influence the mechanical (tensile, flexural and compression strength) properties, thermal (conductivity and insulation) properties, acoustic (sound absorption and transmission) properties, and dielectric performance of FRPCs, enabling weight reduction, improved insulation, and multifunctional capabilities. Reported studies demonstrate that when properly dispersed with an optimal amount, HGMs significantly enhance mechanical properties, thermal stability, and acoustic damping, while maintaining processability. Despite these advantages, challenges remain regarding interfacial adhesion (agglomeration) and filler dispersion. The review concludes by emphasizing the need for advanced surface modification strategies, hybrid filler systems, and sustainable processing methods to fully exploit HGMs in next-generation high-performance FRPCs. Full article
(This article belongs to the Section Advanced Composites)
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26 pages, 6742 KB  
Article
Sustainable Concrete with Waste Tire Rubber and Recycled Steel Fibers: Experimental Insights and Hybrid PINN–CatBoost Prediction
by Ali Serdar Ecemiş, Sadik Alper Yildizel, Alexey N. Beskopylny, Sergey A. Stel’makh, Evgenii M. Shcherban’, Ceyhun Aksoylu, Emrah Madenci and Yasin Onuralp Özkılıç
Polymers 2025, 17(21), 2910; https://doi.org/10.3390/polym17212910 - 30 Oct 2025
Viewed by 328
Abstract
The growing environmental concern over waste tire accumulation necessitates innovative recycling strategies in construction materials. Therefore, this study aims to develop and evaluate sustainable concrete by integrating waste tire rubber (WTR) aggregates of different sizes and recycled waste tire steel fibers (WTSFs), assessing [...] Read more.
The growing environmental concern over waste tire accumulation necessitates innovative recycling strategies in construction materials. Therefore, this study aims to develop and evaluate sustainable concrete by integrating waste tire rubber (WTR) aggregates of different sizes and recycled waste tire steel fibers (WTSFs), assessing their combined effects on the mechanical and microstructural performance of concrete through experimental and analytical approaches. WTR aggregates, consisting of fine (0–4 mm), small coarse (5–8 mm), and large coarse (11–22 mm) particles, were used at substitution rates of 0–20%; WTSF was used at volumetric dosages of 0–2%, resulting in a total of 40 mixtures. Mechanical performance was evaluated using density and pressure resistance tests, while microstructural properties were assessed using scanning electron microscopy (SEM) and energy-dispersive X-ray spectroscopy (EDS). The findings indicate systematic decreases in density and compressive strength with increasing WTR ratio; the average strength losses were approximately 12%, 20%, and 31% at 5%, 10%, and 20% for WTR substitution, respectively. Among the WTR types, the most negative effect occurred in fine particles (FWTR), while the least negative effect occurred in coarse particles (LCWTR). The addition of WTSF compensated for losses at low/medium dosages (0.5–1.0%) and increased strength by 2–10%. However, high dosages (2.0%) reduced strength by 20–40% due to workability issues, fiber clumping, and void formation. The highest strength was achieved in the 5LCWTR–1WTSF mixture at 36.98 MPa (≈6% increase compared to the reference/control concrete), while the lowest strength was measured at 16.72 MPa in the 20FWTR–2WTSF mixture (≈52% decrease compared to the reference/control). A strong positive correlation was found between density and strength (r, Pearson correlation coefficient, ≈0.77). SEM and EDX analyses confirmed the weak matrix–rubber interface and the crack-bridging effect of steel fibers in mixtures containing fine WTR. Additionally, a hybrid prediction model combining physics-informed neural networks (PINNs) and CatBoost, supported by data augmentation strategies, accurately estimated compressive strength. Overall, the results highlight that optimized integration of WTR and WTSF enables sustainable concrete production with acceptable mechanical and microstructural performance. Full article
(This article belongs to the Special Issue Recycling of Plastic and Rubber Wastes, 2nd Edition)
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14 pages, 3245 KB  
Article
Investigation of Structural Properties of n-Hexane and Decane under Different Cooling Regimes by Raman Spectroscopy
by Sokolov Dmitriy Yurievich, Tolynbekov Aidos Beibitbekuly, Korshikov Yevgeniy Sergeyevich, Filippov Vladimir Dmitrievich and Aldiyarov Abdurakhman Ualievich
Crystals 2025, 15(11), 938; https://doi.org/10.3390/cryst15110938 - 30 Oct 2025
Viewed by 82
Abstract
The glass-forming ability of short-chain alkanes remains a fundamental challenge in condensed matter physics. This study investigates the structural properties of n-hexane (C6H14) and decane (C10H22) under two distinct cooling regimes using Raman spectroscopy: fast [...] Read more.
The glass-forming ability of short-chain alkanes remains a fundamental challenge in condensed matter physics. This study investigates the structural properties of n-hexane (C6H14) and decane (C10H22) under two distinct cooling regimes using Raman spectroscopy: fast cooling (~50–100 K/s via contact freezing on a copper substrate at 77 K) and conventional cooling (~1–5 K/s). Despite employing rapid cooling protocols, both alkanes underwent crystallization without forming amorphous phases. n-Hexane formed a defective crystalline structure characterized by broad spectral bands (FWHM ~40–45 cm−1) and diffuse phase transitions in the 180–200 K range, while decane exhibited highly ordered crystalline structures with sharp spectral features (FWHM ~15–20 cm−1) and abrupt transitions at 220–240 K. Quantitative analysis of characteristic Raman bands (skeletal deformations, C-C stretching, and C-H stretching vibrations) revealed fundamental differences in crystallization mechanisms related to molecular chain length. The study demonstrates that contact freezing methods are fundamentally incapable of achieving the extreme cooling rates (>104 K/s) and ultra-thin film conditions (<1 μm) necessary for alkane vitrification. These findings establish spectroscopic diagnostic criteria for distinguishing between defective and well-ordered crystalline structures and define the limitations of conventional cryogenic techniques for glass formation in alkanes. Full article
(This article belongs to the Section Organic Crystalline Materials)
21 pages, 4735 KB  
Article
Advancing Sustainable Production of High-Performance Cellulose Pulps
by María Guadalupe Morán-Aguilar, Iván Costa-Trigo, Gabriela A. Bastida, André Mazega, Josep Duran, José Manuel Domínguez and Fabiola Vilaseca
Materials 2025, 18(21), 4968; https://doi.org/10.3390/ma18214968 - 30 Oct 2025
Viewed by 142
Abstract
With a growing demand for renewable resources in high-performance materials, sustainable methods are preferred for their lower environmental impact and alignment with circular economy principles. Among these, enzymatic hydrolysis remains relatively underexplored yet shows strong potential for cellulose fibrillation, offering a promising route [...] Read more.
With a growing demand for renewable resources in high-performance materials, sustainable methods are preferred for their lower environmental impact and alignment with circular economy principles. Among these, enzymatic hydrolysis remains relatively underexplored yet shows strong potential for cellulose fibrillation, offering a promising route that may lower energy requirements by minimizing the need for extensive refining compared to conventional mechanical or chemical approaches. In this study, enzyme cocktails rich in cellulase and xylanase were applied to three industrial pulps, sulphite, bleached Kraft eucalyptus and thermomechanical pine, to produce high-performance cellulose pulps. Treatments were carried out using varying enzyme loads (5–40 filter paper units per gram of dry pulp, FPU/gdp) and reaction times (1–16 h). The resulting chemical composition, structural morphology, and physical–mechanical properties were systematically evaluated. The findings revealed that pulp composition strongly influenced enzymatic treatment, affecting surface fibrillation, fibre aggregation, swelling, and fibre shortening. Under optimized conditions, enzymatic pretreatment significantly enhanced paper performance, with improvements in tensile strength, air permeability, hydrophobicity, and internal bonding. Overall, enzymatic hydrolysis represents a sustainable solution and a strategy which could reduce energy expenditures to high-performance cellulose pulps, suitable as reinforcing fibres in packaging applications. Full article
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27 pages, 5100 KB  
Article
Electrochemical and Computational Analyses of Thiocolchicoside as a New Corrosion Inhibitor for Biomedical Ti6Al4V Alloy in Saline Solution: DFT, NBO, and MD Approaches
by Inam M. A. Omar, Ibrahim H. Elshamy, Shimaa Abdel Halim and Magdy A. M. Ibrahim
Surfaces 2025, 8(4), 77; https://doi.org/10.3390/surfaces8040077 - 30 Oct 2025
Viewed by 62
Abstract
The Ti6Al4V alloy is considered the most beneficial of the titanium alloys for use in biomedical applications. However, it corrodes when exposed to various biocompatible fluids. This investigation aims to evaluate the corrosion inhibition performance of the Ti6Al4V in a saline solution (SS) [...] Read more.
The Ti6Al4V alloy is considered the most beneficial of the titanium alloys for use in biomedical applications. However, it corrodes when exposed to various biocompatible fluids. This investigation aims to evaluate the corrosion inhibition performance of the Ti6Al4V in a saline solution (SS) using thiocolchicoside (TCC) drug as an environmentally acceptable corrosion inhibitor. The corrosion assessments were conducted using potentiodynamic polarization curves (PPCs), open-circuit potential (OCP), and electrochemical impedance spectroscopy (EIS) methodologies, supplemented by scanning electron microscopy (SEM), energy-dispersive X-ray (EDS) analysis, atomic force microscopy (AFM), and contact angle (CA) measurements. The outcomes indicated that the inhibitory efficacy improved with higher TCC concentrations (achieving 92.40% at 200 mg/L of TCC) and diminished with an increase in solution temperature. TCC’s physical adsorption onto the surface of the Ti6A14V, which adheres to the Langmuir adsorption isotherm, explains its mitigating power. The TCC acts as a mixed-type inhibitor. The adsorption and inhibitory impact of TCC were examined at various temperatures using PPC and EIS. When TCC is present, the corrosion’s apparent activation energy is higher (35.79 kJ mol−1) than when it is absent (14.46 kJ mol−1). In addition, the correlation between the structural properties of thiocolchicoside (TCC) and its corrosion inhibition performance was systematically analyzed. Density Functional Theory (DFT) calculations were utilized to characterize the adsorption mechanism, supported by Natural Bond Orbital (NBO) analysis and Molecular Dynamics (MD) simulations. The combined computational and electrochemical findings confirm that TCC provides effective and enhanced corrosion protection for the Ti6Al4V alloy in a saline environment. These characteristics provide compelling evidence for the suitability of these pharmaceutical compounds as promising corrosion inhibitors. Full article
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21 pages, 5438 KB  
Article
Study on the Improved Black Soil Structure Under Biological Tillage on Brassica chinensis L. Yield
by Baoguang Wu, Pu Chen, Zhipeng Yin, Shun Xu, Yuping Liu, Qiuju Wang, Zhenyu Wang and Junting Ye
Agronomy 2025, 15(11), 2532; https://doi.org/10.3390/agronomy15112532 - 30 Oct 2025
Viewed by 78
Abstract
The degradation of soil structure in black soils has become a key factor limiting the productivity of farmland ecosystems. However, systematic studies on restoring soil physical properties and improving crop yields through biological tillage remain scarce. In this study, Eisenia fetida was employed [...] Read more.
The degradation of soil structure in black soils has become a key factor limiting the productivity of farmland ecosystems. However, systematic studies on restoring soil physical properties and improving crop yields through biological tillage remain scarce. In this study, Eisenia fetida was employed as a biological tillage agent to create soil macropores. An orthogonal experiment with three factors was conducted to investigate the mechanisms by which different gradients of soil moisture, decomposed straw, and soil compaction affect soil pore structure and the yield of Brassica chinensis L. X-ray-computed tomography (CT) was used to quantitatively characterize the macropore network mediated by earthworms. The results indicated that the critical threshold conditions for optimized biological tillage were 50 g of decomposed straw, a compaction of 50–150 kPa, and a soil moisture content of 30–37%. Under these conditions, earthworm activity significantly enhanced the leaf dry weight of Brassica chinensis L. by approximately 55.29%, while root dry weight increased by 96.60%. Compared with treatments of low soil moisture combined with 50 g of decomposed straw, higher moisture levels further increased total biomass by 75.46%. Compared with the control, earthworm-induced macropores had 27 times more pore throats than abiotic pores, and network models showed significantly improved connectivity, indicating enhanced soil structure. This study revealed a synergistic threshold of water–food–physical resistance regulation for soil structural improvement under biological tillage and innovatively proposed a biological tillage evaluation system based on CT-quantified pore networks and root structure–function relationships. These findings provide a theoretical basis for the ecological restoration of degraded black soils. Full article
(This article belongs to the Section Farming Sustainability)
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